5-chloranyl-3-(cyanomethyl)-2-ethyl-benzenecarbonitrile

Systemtic Name: 5-chloranyl-3-(cyanomethyl)-2-ethyl-benzenecarbonitrile Openeye Name: 5-chloro-3-(cyanomethyl)-2-ethyl-benzonitrile CAS Name: 5-chloro-3-(cyanomethyl)-2-ethylbenzonitrile IUPAC Name: 5-chloro-3-(cyanomethyl)-2-ethylbenzonitrile Traditional Name: 5-chloro-3-(cyanomethyl)-2-ethyl-benzonitrile Formula: C11H9ClN2 MolecularWeight: 204.65556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1C#N)Cl)CC#N

Isomeric SMILES

CCC1=C(C=C(C=C1C#N)Cl)CC#N

InChI

InChI=1S/C11H9ClN2/c1-2-11-8(3-4-13)5-10(12)6-9(11)7-14/h5-6H,2-3H2,1H3